COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL171327
Chemical Name: 5,5-dimethyl-2-[1-({2-[4-(phenylcarbonyl)piperazin-1-yl]ethyl}amino)ethylidene]cyclohexane-1,3-dione
Smiles: CC(=C1C(=O)CC(CC1=O)(C)C)NCCN1CCN(CC1)C(=O)c1ccccc1

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Molecular Weight: 397.52
Empirical Formula: C23H31N3O3

Physical State: Dry powder
Available Amount: 17 mg

Lipinsky:
logP: 1.259
Rotatable bonds: 2
H-donors: 1
H-acceptors: 3
PSA: 69
Number of rings: 3

     

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